CID 14872606

N-(cyclohexylmethyl)prop-2-enamide

Structural Information

Molecular Formula
C10H17NO
SMILES
C=CC(=O)NCC1CCCCC1
InChI
InChI=1S/C10H17NO/c1-2-10(12)11-8-9-6-4-3-5-7-9/h2,9H,1,3-8H2,(H,11,12)
InChIKey
XJKTZVTYQXQHHB-UHFFFAOYSA-N
Compound name
N-(cyclohexylmethyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

522
Patents

167.13101 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.138286 139.3
[M+Na]+ 190.120228 142.7
[M-H]- 166.123734 141.6
[M+NH4]+ 185.164833 159.1
[M+K]+ 206.094168 140.9
[M+H-H2O]+ 150.128270 133.3
[M+HCOO]- 212.129211 159.8
[M+CH3COO]- 226.144861 180.7
[M+Na-2H]- 188.105676 143.0
[M]+ 167.13046142 133.8
[M]- 167.13155858 133.8
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