CID 170452684

2659259-65-9

Structural Information

Molecular Formula
C10H14N2O2
SMILES
CN(CCC(C1=CC=CC=C1)O)N=O
InChI
InChI=1S/C10H14N2O2/c1-12(11-14)8-7-10(13)9-5-3-2-4-6-9/h2-6,10,13H,7-8H2,1H3
InChIKey
PBZDQZIBWYIGIZ-UHFFFAOYSA-N
Compound name
N-(3-hydroxy-3-phenylpropyl)-N-methylnitrous amide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

194.10553 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.11281 142.2
[M+Na]+ 217.09475 147.4
[M-H]- 193.09825 146.9
[M+NH4]+ 212.13935 161.3
[M+K]+ 233.06869 147.5
[M+H-H2O]+ 177.10279 135.0
[M+HCOO]- 239.10373 168.6
[M+CH3COO]- 253.11938 191.6
[M+Na-2H]- 215.08020 148.4
[M]+ 194.10498 143.7
[M]- 194.10608 143.7
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

No patent data available for this compound.