CID 133662627

N-[(3,4-dihydro-2h-pyran-2-yl)methylidene]-2-methylpropane-2-sulfinamide

Structural Information

Molecular Formula
C10H17NO2S
SMILES
CC(C)(C)S(=O)/N=C/C1CCC=CO1
InChI
InChI=1S/C10H17NO2S/c1-10(2,3)14(12)11-8-9-6-4-5-7-13-9/h5,7-9H,4,6H2,1-3H3/b11-8+
InChIKey
QPJYKYVQUJFHAR-DHZHZOJOSA-N
Compound name
(NE)-N-(3,4-dihydro-2H-pyran-2-ylmethylidene)-2-methylpropane-2-sulfinamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.098 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.105276 147.8
[M+Na]+ 238.087218 153.3
[M-H]- 214.090724 153.0
[M+NH4]+ 233.131823 166.0
[M+K]+ 254.061158 153.0
[M+H-H2O]+ 198.095260 141.7
[M+HCOO]- 260.096201 163.9
[M+CH3COO]- 274.111851 188.5
[M+Na-2H]- 236.072666 151.7
[M]+ 215.09745142 149.2
[M]- 215.09854858 149.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe