CID 11298644

Tert-butyl n-[1-(sulfanylmethyl)cyclopropyl]carbamate

Structural Information

Molecular Formula
C9H17NO2S
SMILES
CC(C)(C)OC(=O)NC1(CC1)CS
InChI
InChI=1S/C9H17NO2S/c1-8(2,3)12-7(11)10-9(6-13)4-5-9/h13H,4-6H2,1-3H3,(H,10,11)
InChIKey
BEPPDGJTELEGPK-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(sulfanylmethyl)cyclopropyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

203.098 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.10528 149.9
[M+Na]+ 226.08722 159.3
[M+NH4]+ 221.13182 159.2
[M+K]+ 242.06116 153.0
[M-H]- 202.09072 157.0
[M+Na-2H]- 224.07267 156.9
[M]+ 203.09745 154.8
[M]- 203.09855 154.8
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