CID 22474683

Refchem:910026

Structural Information

Molecular Formula
C10H13NO
SMILES
CC1(CCC2=CC=CC=C2O1)N
InChI
InChI=1S/C10H13NO/c1-10(11)7-6-8-4-2-3-5-9(8)12-10/h2-5H,6-7,11H2,1H3
InChIKey
ZQFGTJLFYMYOQE-UHFFFAOYSA-N
Compound name
2-methyl-3,4-dihydrochromen-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

119
References

24
Patents

163.09972 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.10700 133.1
[M+Na]+ 186.08894 140.8
[M-H]- 162.09244 137.9
[M+NH4]+ 181.13354 155.2
[M+K]+ 202.06288 139.5
[M+H-H2O]+ 146.09698 127.7
[M+HCOO]- 208.09792 154.2
[M+CH3COO]- 222.11357 146.8
[M+Na-2H]- 184.07439 142.6
[M]+ 163.09917 130.4
[M]- 163.10027 130.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe