CID 13953866

(2-cyclopropylphenyl)methanamine

Structural Information

Molecular Formula
C10H13N
SMILES
C1CC1C2=CC=CC=C2CN
InChI
InChI=1S/C10H13N/c11-7-9-3-1-2-4-10(9)8-5-6-8/h1-4,8H,5-7,11H2
InChIKey
XSUSWKYDSROWDL-UHFFFAOYSA-N
Compound name
(2-cyclopropylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

147.1048 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.112076 127.3
[M+Na]+ 170.094018 136.4
[M-H]- 146.097524 134.7
[M+NH4]+ 165.138623 143.6
[M+K]+ 186.067958 133.1
[M+H-H2O]+ 130.102060 121.0
[M+HCOO]- 192.103001 152.6
[M+CH3COO]- 206.118651 181.5
[M+Na-2H]- 168.079466 134.5
[M]+ 147.10425142 127.5
[M]- 147.10534858 127.5
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