CID 75452402

(5-chloro-2,3-dihydro-1-benzofuran-7-yl)methanamine hydrochloride

Structural Information

Molecular Formula
C9H10ClNO
SMILES
C1COC2=C1C=C(C=C2CN)Cl
InChI
InChI=1S/C9H10ClNO/c10-8-3-6-1-2-12-9(6)7(4-8)5-11/h3-4H,1-2,5,11H2
InChIKey
UXKCHKSLFMYHNM-UHFFFAOYSA-N
Compound name
(5-chloro-2,3-dihydro-1-benzofuran-7-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.04509 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.05237 137.2
[M+Na]+ 206.03431 146.8
[M-H]- 182.03781 142.0
[M+NH4]+ 201.07891 159.3
[M+K]+ 222.00825 143.4
[M+H-H2O]+ 166.04235 132.8
[M+HCOO]- 228.04329 155.9
[M+CH3COO]- 242.05894 151.3
[M+Na-2H]- 204.01976 143.2
[M]+ 183.04454 138.2
[M]- 183.04564 138.2
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.