CID 2775258

Phenyl(pyridin-2-yl)methanamine dihydrochloride

Structural Information

Molecular Formula
C12H12N2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=N2)N
InChI
InChI=1S/C12H12N2/c13-12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-9,12H,13H2
InChIKey
BAEZXIOBOOEPOS-UHFFFAOYSA-N
Compound name
phenyl(pyridin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

187
Patents

184.10005 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.10733 140.5
[M+Na]+ 207.08927 154.8
[M+NH4]+ 202.13387 149.9
[M+K]+ 223.06321 147.1
[M-H]- 183.09277 145.7
[M+Na-2H]- 205.07472 151.3
[M]+ 184.09950 144.1
[M]- 184.10060 144.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

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