CID 3052862

Brn 2642357

Structural Information

Molecular Formula
C11H17NO
SMILES
CCCC1(CC2CC1C=C2)C(=O)N
InChI
InChI=1S/C11H17NO/c1-2-5-11(10(12)13)7-8-3-4-9(11)6-8/h3-4,8-9H,2,5-7H2,1H3,(H2,12,13)
InChIKey
MNKMXANEIVDRFR-UHFFFAOYSA-N
Compound name
2-propylbicyclo[2.2.1]hept-5-ene-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.13101 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.138286 143.0
[M+Na]+ 202.120228 150.0
[M-H]- 178.123734 145.4
[M+NH4]+ 197.164833 169.6
[M+K]+ 218.094168 147.4
[M+H-H2O]+ 162.128270 138.9
[M+HCOO]- 224.129211 164.8
[M+CH3COO]- 238.144861 183.9
[M+Na-2H]- 200.105676 146.0
[M]+ 179.13046142 141.9
[M]- 179.13155858 141.9
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.