CID 10203113

1-(3,4-dihydro-2h-1-benzopyran-2-yl)methanamine

Structural Information

Molecular Formula
C10H13NO
SMILES
C1CC2=CC=CC=C2O[C@H]1CN
InChI
InChI=1S/C10H13NO/c11-7-9-6-5-8-3-1-2-4-10(8)12-9/h1-4,9H,5-7,11H2/t9-/m1/s1
InChIKey
BSRHATGBRQMDRF-SECBINFHSA-N
Compound name
[(2R)-3,4-dihydro-2H-chromen-2-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

586
Patents

163.09972 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.10700 132.8
[M+Na]+ 186.08894 139.4
[M-H]- 162.09244 137.2
[M+NH4]+ 181.13354 152.8
[M+K]+ 202.06288 137.9
[M+H-H2O]+ 146.09698 126.8
[M+HCOO]- 208.09792 153.9
[M+CH3COO]- 222.11357 179.7
[M+Na-2H]- 184.07439 141.3
[M]+ 163.09917 129.8
[M]- 163.10027 129.8
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