CID 27984023

61863-41-0

Structural Information

Molecular Formula
C9H15N
SMILES
C1[C@@H]2C[C@H]([C@H]1C=C2)CCN
InChI
InChI=1S/C9H15N/c10-4-3-9-6-7-1-2-8(9)5-7/h1-2,7-9H,3-6,10H2/t7-,8+,9-/m1/s1
InChIKey
IGRYFUUCWNBVDN-HRDYMLBCSA-N
Compound name
2-[(1S,2S,4S)-2-bicyclo[2.2.1]hept-5-enyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

137.12045 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.127726 130.9
[M+Na]+ 160.109668 138.0
[M-H]- 136.113174 133.3
[M+NH4]+ 155.154273 157.4
[M+K]+ 176.083608 135.6
[M+H-H2O]+ 120.117710 126.4
[M+HCOO]- 182.118651 154.1
[M+CH3COO]- 196.134301 176.5
[M+Na-2H]- 158.095116 135.1
[M]+ 137.11990142 128.8
[M]- 137.12099858 128.8
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